2-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxyacetic acid


Catalog No:   FT-0773152

CAS No:   94133-41-2

  • Chemical Name:  2-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxyacetic acid
  • Molecular Formula:  C12H22O3
  • Molecular Weight:  214.3 g/mol
  • InChI Key:  CILPHQCEVYJUDN-AXFHLTTASA-N
  • InChI:  InChI=1S/C12H22O3/c1-8(2)10-5-4-9(3)6-11(10)15-7-12(13)14/h8-11H,4-7H2,1-3H3,(H,13,14)/t9-,10+,11-/m0/s1

Product pricing and availability information
Assay Pack Size Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
CAS: 94133-41-2
MF: C12H22O3
Density: 1.01g/cm3
Flash_Point: 122.5ºC
Melting_Point: N/A
Product_Name: 2-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxyacetic acid
Symbol: GHS07
Bolling_Point: 293.5ºC at 760mmHg
FW: 214.30100
MF: C12H22O3
Density: 1.01g/cm3
Computational_Chemistry: ['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 465 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :213 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :3 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
More_Info: ['1 . Appearance Colourless 粘稠Liquid ', '2 . Density(g/mL 25ºC)102 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºCAtmospheric pressure)Unknow ', '5 . Boiling point(ºC)163-164 ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point(ºC,)110 ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)Unknow ', '12 . Saturated vapor pressure(kPa,60ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient (25℃)Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility (mg/mL) Unknow']
Exact_Mass: 214.15700
Flash_Point: 122.5ºC
PSA: 46.53000
Molecular_Structure: ['五分子性质数据 ', '1 . Molar refractive index 5886 ', '2 . Molar volume (m3/mol)2114 ', '3 . Parachor (902K)5154 ', '4 . Surface tension 353 ', '5 . Dielectric constant N/A ', '6 偶极距(10 -24cm 3)N/A ', '7 . Polarizability 2333']
LogP: 2.54840
Bolling_Point: 293.5ºC at 760mmHg
FW: 214.30100
Refractive_Index: n20/D 1.465(lit.)
Personal_Protective_Equipment: Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Symbol: GHS07
Safety_Statements: 26-36
Warning_Statement: P261-P305 + P351 + P338
Hazard_Codes: Xi: Irritant;
HS_Code: 2918990090
RIDADR: NONH for all modes of transport
Risk_Statements(EU): 36/37/38

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